⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21919204 | 0.87 | — | — | |
| SCHEMBL21919207 | 0.83 | — | — | |
| SCHEMBL21917972 | 0.77 | — | — | |
| SCHEMBL21919205 | 0.73 | — | — | |
| SCHEMBL21919203 | 0.73 | — | — | |
| SCHEMBL21919206 | 0.73 | — | — | |
| SCHEMBL21919208 | 0.73 | — | — | |
| SCHEMBL21815229 | 0.68 | — | — | |
| SCHEMBL21917969 | 0.62 | — | — | |
| SCHEMBL21815290 | 0.62 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020065492-A1 | HYDROFLUOROETHERS AND METHODS OF USING SAME | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2020-04-02 | — | — | WO | disclosed |